N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]amino]ethanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]amino]ethanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-[[(S)-p-tolyl(2-thienyl)methyl]amino]acetamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]amino]acetamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]amino]acetamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-[[(S)-p-tolyl(2-thienyl)methyl]amino]acetamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2=CC=CS2)NCC(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C25H26N4O2S/c1-17-11-13-19(14-12-17)24(21-10-7-15-32-21)26-16-22(30)27-23-18(2)28(3)29(25(23)31)20-8-5-4-6-9-20/h4-15,24,26H,16H2,1-3H3,(H,27,30)/t24-/m0/s1